Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | SKP2 | Q13309 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 2/20 | 0.39 |
| ▸ | NOS3 | P29474 | 1/20 | 0.39 |
| ▸ | NOS1 | P29475 | 1/20 | 0.39 |
| ▸ | NOS2 | P35228 | 1/20 | 0.39 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA4 | P22748 | 1/20 | 0.39 |
| ▸ | CA6 | P23280 | 1/20 | 0.39 |
| ▸ | CA5A | P35218 | 1/20 | 0.39 |
| ▸ | CA7 | P43166 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.39 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.39 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 3/20 | 0.37 |
| ▸ | RAB9A | P51151 | 3/20 | 0.37 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL29923559 | 0.96 | SKP2 (0.42) | CYP1A2CYP2A6SKP2CA2NOS3 | |
| SCHEMBL1063295 | 0.96 | SKP2 (0.42) | CYP1A2CYP2A6SKP2CA2NOS3 | |
| Benzene SCHEMBL27889609 | 0.81 | SKP2 (0.66) | TP53SKP2CA2NPC1RAB9A | |
| SCHEMBL7442769 | 0.79 | SKP2 (0.53) | TP53SKP2CA2CA12CA1 | |
| SCHEMBL14899824 | 0.78 | NOS3 (0.42) | CYP1A2CYP2A6SKP2CA2NOS3 | |
| SCHEMBL1300912 | 0.78 | GAA (0.54) | SKP2CA2CA12CA1CA4 | |
| SCHEMBL691933 | 0.78 | CALM1 (0.48) | CA2CA12CA1CA9CA14 | |
| SCHEMBL841230 | 0.76 | SKP2 (0.70) | TP53SKP2CA2CA1NPC1 | |
| SCHEMBL7747249 | 0.76 | SKP2 (0.64) | CYP1A2CYP2A6SKP2NOS3NOS1 | |
| SCHEMBL11441801 | 0.76 | LOXL2 (0.44) | CYP2A6SKP2CA2CA12CA1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102911178-A | Tripolyindole derivative and preparation method thereof | UNIV EAST CHINA NORMAL | 2013-02-06 | — | — | CN | disclosed |